Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 9/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | PPARG | P37231 | 4/20 | 0.54 |
| ▸ | FABP2 | P12104 | 2/20 | 0.54 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.46 |
| ▸ | CNR1 | P21554 | 6/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11512906 | 0.88 | CES1 (0.47) | MAPTPPARGCES2CES1TSHR | |
| SCHEMBL11514429 | 0.85 | PPARA (0.56) | PPARACYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL11512293 | 0.80 | MRGPRX4 (0.50) | PPARAMEN1MAPTKMT2ATSHR | |
| SCHEMBL11512099 | 0.80 | PPARA (0.50) | PPARACYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL11513260 | 0.79 | CES1 (0.56) | PPARACYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL10554594 | 0.77 | PPARA (0.68) | PPARACYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL11513032 | 0.77 | KMT2A (0.42) | MEN1MAPTKMT2ACES1TSHR | |
| SCHEMBL11530819 | 0.76 | MAP4K4 (0.47) | PPARACYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL10886243 | 0.74 | PPARA (0.45) | PPARACYP1A2CYP3A4MEN1MAPT | |
| SCHEMBL12260670 | 0.74 | CES1 (0.52) | CYP1A2CYP3A4MEN1MAPTKMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4147791-A | 1-Substituted-1,2,4-triazole fungicidal compositions and methods for combatting fungi that infect or attack plants | BAYER AKTIENGESELLSCHAFT (DE) | 1979-04-03 | — | — | US | disclosed |
| US-4048318-A | 1-Substituted-1,2,4-triazole fungicides | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-13 | — | — | US | disclosed |